Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MKKMSLFQNMKSKLLPIAAVSVLTAGIFAGAELQQTEKASAKKQDKAEIRNVIVMIGDGMGTPYIRAYRSMKNNGDTPNNPKLTE-FDRN---LTGMM-MTHPDDPDYNITDSAAAGTALATGVKTYNNAIGVDKNGKKVKSVLEEAKQQGKSTGLVATSEINHATPAAYGAHNESRKNMDQIANSYMDDKIKGKHKIDVLLGGGKSYFNRKD------------------------RNLTKEFKQAGYSYVTTKQALKKNKDQQVLGLFADGGLAKALDRD-------SKTPSLKDMTVSAIDRLNQNKKGFFLMVEGSQIDWAAHDNDTVGAMSEVKDFEQAYKAAIEFAKKDKHTLVIATADHTTGGFTIGANGE-----------------K--NWH------AEPILSAKKTPEFMAKKISE-----G--KPVKDVLARYANLKVTSEEIKSVEAAAQA------------------------DKSKGASKAIIKIFNTRSNSGWTSTDHTGEEVPVYAYGPGKE--KFRGLINNTDQANIIFKILKTGK 3WBH Chain:A ((31-527)) -----------------------------------------------EVKNVILMIGDGMGPQQVGLLETYANQAPDSIYDGEPTAFHQLAKEGVVGFSLTHPE--DAVVVDSACSATQLASGIYSGSEVIGIDAEGNPVETVLELAQARGKATGLVSDTRLTHATPAAFAAHQPHRSLENEIAVDMLEV------GPDVMLSGGLRHWVPQSASEDAEVTSLMDGAYEPASKRQDDRNLLAEAVEKGYGLAFSREQLEADQSDKLLGLFANSGMADGIEYRNTRDDADRREPTLHEMTQAALNRLEQDEDGFFLMVEGGQIDWAGHSNDAGTMLNEMVKFEEAVQGVYDWAKGREDTVILVTADHETGAFGLSYSSADLPEPQSKSGPAFAERDYAPNFNFGDFALLDSLYHQKASFSTLLSEFGALEEEQRTPARLMEMVNANSDFQIDEEQAEAVLADKPNPYHVEGHSYLEAEEVPAIQDFDAFYPYNDRGNVLGRVLGTAQNVVWGTGTHTHTPVNVFAWGPAETILPVSSIQHHSEVGQYLKSLVE---

General information: TITO was launched using: RESULT: Template: 3WBH.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain A - contact count / total energy / energy per contact / energy per residue : 2557 -141121 -55.19 -350.18 target 2D structure prediction score : 0.68 Monomeric hydrophicity matching model chain A : 0.75 3D Compatibility (PKB) : -55.19 2D Compatibility (Sec. Struct. Predict.) : 0.68 1D Compatibility (Hydrophobicity) : 0.75 QMean score : 0.551

(partial model without unconserved sides chains): PDB file : Tito_3WBH.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3WBH-query.scw PDB file : Tito_Scwrl_3WBH.pdb: